SCHEMBL8029909

SCHEMBL8029909

Cn1c(Cc2ccc(C#N)cc2)nc2c(NS(=O)(=O)c3ccc4ccccc4c3)cccc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.49
GLO1 Q04760 3/20 0.48
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
TDP1 Q9NUW8 1/20 0.47
PLAU P00749 1/20 0.46
HTR6 P50406 1/20 0.45
BRPF1 P55201 8/20 0.45
BRD1 O95696 5/20 0.45
BRPF3 Q9ULD4 4/20 0.45
SLC40A1 Q9NP59 1/20 0.44
BRD9 Q9H8M2 3/20 0.43
BRD4 O60885 2/20 0.43
KAT6A Q92794 1/20 0.41
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
FGB P02675 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8026661 0.90 GLO1 (0.49) F2GLO1TDP1BRPF1BRD1
Hydrochloric Acid SCHEMBL8027077 0.83 F2 (0.69) F2GLO1MEN1KMT2ATDP1
SCHEMBL8032270 0.82 F2 (0.72) F2BRPF1BRD1BRPF3BRD9
SCHEMBL8109694 0.81 GLO1 (0.48) GLO1TDP1BRPF1BRD1BRPF3
SCHEMBL8026558 0.79 GLO1 (0.48) F2GLO1TDP1BRPF1SLC40A1
SCHEMBL8017545 0.79 F2 (0.48) F2GLO1MEN1KMT2ATDP1
SCHEMBL7981352 0.78 GLO1 (0.47) GLO1BRPF1BRD1BRPF3SLC40A1
SCHEMBL8032287 0.77 GLO1 (0.44) F2GLO1TDP1HTR6SLC40A1
SCHEMBL8028576 0.77 CDC25A (0.48) F2GLO1MEN1KMT2ATDP1
SCHEMBL8016259 0.76 F2 (0.58) F2BRPF1BRD1BRPF3BRD9

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6114532-A ANTICOAGULANT BOEHRINGER INGELHEIM PHARMA KG (DE) 2000-09-05 US disclosed